N-(1,3-benzodioxol-5-ylmethyl)-N-[(2,5-dimethylpyrazol-3-yl)methyl]quinoline-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2,5-dimethylpyrazol-3-yl)methyl]quinoline-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2,5-dimethylpyrazol-3-yl)methyl]quinoline-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2,5-dimethyl-3-pyrazolyl)methyl]-3-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2,5-dimethylpyrazol-3-yl)methyl]quinoline-3-carboxamide Traditional Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-piperonyl-quinoline-3-carboxamide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5N=C4)C

Isomeric SMILES

CC1=NN(C(=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5N=C4)C

InChI

InChI=1S/C24H22N4O3/c1-16-9-20(27(2)26-16)14-28(13-17-7-8-22-23(10-17)31-15-30-22)24(29)19-11-18-5-3-4-6-21(18)25-12-19/h3-12H,13-15H2,1-2H3